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Ammonium → 1-chloro-9-(1-methyl-1H-pyrazol-4-yl)-N-pyridin-3-ylbenzo[c]-1,6-naphthyridin-6-amine

HRID 1556568
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반응식

HRID 1556568 반응식
[CH2:38]1[O:39][CH2:40][CH2:41][CH2:42]1.[CH3:30][C:31]([CH3:32])([O-:33])[CH3:34].[CH3:43][CH2:44][O:45][C:46](=[O:47])[CH3:48].[Cl-:36].[Cl:1][c:2]1[c:3]2[c:4]3[c:5]([c:6]([Cl:12])[n:7][c:8]2[cH:9][cH:10][n:11]1)[cH:13][cH:14][c:15](-[c:17]1[cH:18][n:19][n:20]([CH3:22])[cH:21]1)[cH:16]3.[NH2:23][c:24]1[cH:25][n:26][cH:27][cH:28][cH:29]1.[NH4+:37].[Na+:35]>>[Cl:1][c:2]1[c:3]2[c:4]3[c:5]([c:6]([NH:23][c:24]4[cH:25][n:26][cH:27][cH:28][cH:29]4)[n:7][c:8]2[cH:9][cH:10][n:11]1)[cH:13][cH:14][c:15](-[c:17]1[cH:18][n:19][n:20]([CH3:22])[cH:21]1)[cH:16]3
참가 물질출처 및 근거반응 노트

참가 물질

9

반응물 8

HCID 223AmmoniumHCID 312ChlorideHCID 923Sodium IonHCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 100093-AminopyridineHCID 45749132-Methylpropan-2-olate
HCID 59375514
1,6-dichloro-9-(1-methyl-1H-pyrazol-4-yl)benzo[c]-1,6-naphthyridine

생성물 1

HCID 593755971-chloro-9-(1-methyl-1H-pyrazol-4-yl)-N-pyridin-3-ylbenzo[c]-1,6-naphthyridin-6-amine

출처 및 근거

ORD 기록
ord-62412f2466e544a184780e7db790d232
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI
10.1039/C8SC04228D

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